8009-0557 Screening compound: ethyl (4E)-4-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]-2,5-dimethylpiperidine-1-carboxylate

8009-0557 Screening compound: ethyl (4E)-4-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]-2,5-dimethylpiperidine-1-carboxylate
8009-0557 Screening compound: ethyl (4E)-4-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]-2,5-dimethylpiperidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-0557
ethyl (4E)-4-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]-2,5-dimethylpiperidine-1-carboxylate

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8009-0557

Molecular Formula

C16H21N5O6 (C16 H21 N5 O6)

Compound Name

ethyl (4E)-4-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]-2,5-dimethylpiperidine-1-carboxylate

IUPAC name

ethyl (4E)-4-[2-(24-dinitrophenyl)hydrazin-1-ylidene]-25-dimethylpiperidine-1-carboxylate

SMILES

CCOC(N(CC1C)C(C)C/C1=N\Nc(ccc([N+]([O-])=O)c1)c1[N+]([O-])=O)=O

InChI

InChI=1S/C16H21N5O6/c1-4-27-16(22)19-9-10(2)14(7-11(19)3)18-17-13-6-5-12(20(23)24)8-15(13)21(25)26/h5-6,8,10-11,17H,4,7,9H2,1-3H3

InChI Key

UHQXUOPXEWVVTK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01460955

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.37

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

4.036

Distribution Coefficient, logD

4.036

Water Solubility, LogSw

-4.11

Polar Surface Area

108.632

Acid Dissociation Constant (pKa)

10.47

Base Dissociation Constant (pKb)

0.89

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with 8009-0557 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-0557?
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What is the minimum amount of 8009-0557 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-0557
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-0557
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8009-0557 available by request